Chemical Bond Acts Like a Mash-Up
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2.#Water;#Acid.Base#Reac1ons
8/24/15 BIOCH 755: Biochemistry I Fall 2015 2.#Water;#Acid.base#reac1ons# Jianhan#Chen# Office#Hour:#M#1:30.2:30PM,#Chalmers#034# Email:#[email protected]# Office:#785.2518# 2.1#Physical#Proper1es#of#Water# • Key$Concepts$2.1$ – Water#molecules,#which#are#polar,#can#form#hydrogen#bonds#with# other#molecules.# – In#ice,#water#molecules#are#hydrogen#bonded#in#a#crystalline#array,#but# in#liquid#water,#hydrogen#bonds#rapidly#break#and#re.form#in#irregular# networks.# – The#aTrac1ve#forces#ac1ng#on#biological#molecules#include#ionic# interac1ons,#hydrogen#bonds,#and#van#der#Waals#interac1ons.# – Polar#and#ionic#substances#can#dissolve#in#water.# (c)#Jianhan#Chen# 2# 1 8/24/15 2.1#Physical#Proper1es#of#Water# • Key$Concepts$2.1$ – The#hydrophobic#effect#explains#the#exclusion#of#nonpolar#groups#as#a# way#to#maximize#the#entropy#of#water#molecules.# – Amphiphilic#substances#form#micelles#or#bilayers#that#hide#their# hydrophobic#groups#while#exposing#their#hydrophilic#groups#to#water.# – Molecules#diffuse#across#membranes#which#are#permeable#to#them# from#regions#of#higher#concentra1on#to#regions#of#lower# concentra1on.# – In#dialysis,#solutes#diffuse#across#a#semipermeable#membrane#from# regions#of#higher#concentra1on#to#regions#of#lower#concentra1on.# (c)#Jianhan#Chen# 3# Human#Body#Mass#Composi1on# (c)#Jianhan#Chen# 4 2 8/24/15 Structure#of#Water# (c)#Jianhan#Chen# 5 Water#Hydrogen#Bonding# ~1.8 Å, 180o Acceptor Donor (c)#Jianhan#Chen# 6# 3 8/24/15 Typical#Bond#Energies# (c)#Jianhan#Chen# 7# Hydrogen#bond#networks#of#water/ice# (c)#Jianhan#Chen# -
Constraint Closure Drove Major Transitions in the Origins of Life
entropy Article Constraint Closure Drove Major Transitions in the Origins of Life Niles E. Lehman 1 and Stuart. A. Kauffman 2,* 1 Edac Research, 1879 Camino Cruz Blanca, Santa Fe, NM 87505, USA; [email protected] 2 Institute for Systems Biology, Seattle, WA 98109, USA * Correspondence: [email protected] Abstract: Life is an epiphenomenon for which origins are of tremendous interest to explain. We provide a framework for doing so based on the thermodynamic concept of work cycles. These cycles can create their own closure events, and thereby provide a mechanism for engendering novelty. We note that three significant such events led to life as we know it on Earth: (1) the advent of collective autocatalytic sets (CASs) of small molecules; (2) the advent of CASs of reproducing informational polymers; and (3) the advent of CASs of polymerase replicases. Each step could occur only when the boundary conditions of the system fostered constraints that fundamentally changed the phase space. With the realization that these successive events are required for innovative forms of life, we may now be able to focus more clearly on the question of life’s abundance in the universe. Keywords: origins of life; constraint closure; RNA world; novelty; autocatalytic sets 1. Introduction The plausibility of life in the universe is a hotly debated topic. As of today, life is only known to exist on Earth. Thus, it may have been a singular event, an infrequent event, or a common event, albeit one that has thus far evaded our detection outside our own planet. Herein, we will not attempt to argue for any particular frequency of life. -
Basic Concepts of Chemical Bonding
Basic Concepts of Chemical Bonding Cover 8.1 to 8.7 EXCEPT 1. Omit Energetics of Ionic Bond Formation Omit Born-Haber Cycle 2. Omit Dipole Moments ELEMENTS & COMPOUNDS • Why do elements react to form compounds ? • What are the forces that hold atoms together in molecules ? and ions in ionic compounds ? Electron configuration predict reactivity Element Electron configurations Mg (12e) 1S 2 2S 2 2P 6 3S 2 Reactive Mg 2+ (10e) [Ne] Stable Cl(17e) 1S 2 2S 2 2P 6 3S 2 3P 5 Reactive Cl - (18e) [Ar] Stable CHEMICAL BONDSBONDS attractive force holding atoms together Single Bond : involves an electron pair e.g. H 2 Double Bond : involves two electron pairs e.g. O 2 Triple Bond : involves three electron pairs e.g. N 2 TYPES OF CHEMICAL BONDSBONDS Ionic Polar Covalent Two Extremes Covalent The Two Extremes IONIC BOND results from the transfer of electrons from a metal to a nonmetal. COVALENT BOND results from the sharing of electrons between the atoms. Usually found between nonmetals. The POLAR COVALENT bond is In-between • the IONIC BOND [ transfer of electrons ] and • the COVALENT BOND [ shared electrons] The pair of electrons in a polar covalent bond are not shared equally . DISCRIPTION OF ELECTRONS 1. How Many Electrons ? 2. Electron Configuration 3. Orbital Diagram 4. Quantum Numbers 5. LEWISLEWIS SYMBOLSSYMBOLS LEWISLEWIS SYMBOLSSYMBOLS 1. Electrons are represented as DOTS 2. Only VALENCE electrons are used Atomic Hydrogen is H • Atomic Lithium is Li • Atomic Sodium is Na • All of Group 1 has only one dot The Octet Rule Atoms gain, lose, or share electrons until they are surrounded by 8 valence electrons (s2 p6 ) All noble gases [EXCEPT HE] have s2 p6 configuration. -
Ocw-5.112-Lec24 the Following Content Is Provided by MIT Opencourseware Under a Creative Commons License
MITOCW | ocw-5.112-lec24 The following content is provided by MIT OpenCourseWare under a Creative Commons license. Additional information about our license and MIT OpenCourseWare in general is available at ocw.mit.edu. Today I would like to start by discussing a timeline. And you will see in a moment what this timeline has to do with. It is obviously only a partial timeline. But let's start here in 1916, as we have done this semester, by talking about the Lewis theory of electronic structure. And his electron pair theory is something we are going to come back to a couple of times during lecture today. Let's move on to 1954. 1954 was an important year in electronic structure theory, because in that year there was awarded, to Linus Pauling, the Nobel Prize in chemistry. Let me write down Pauling here. And if you are interested in knowing something about what Pauling was awarded the Nobel Prize in chemistry for, I will show you over here on the side boards. What you are going to see here, if you read this citation for Linus Carl Pauling in 1954 for the Nobel Prize in chemistry, his prize was awarded principally for his contributions to our understanding of the nature of the chemical bond. If you think back to the elegant title of the paper by Lewis that we started out our discussion of acid-base theory with, it was a paper entitled "The Atom and the Molecule." And now we have gotten to Pauling, in 1954, who is being awarded a Nobel Prize in chemistry for the nature of the chemical bond. -
A New Way for Probing Bond Strength J
A New Way for Probing Bond Strength J. Klein, H. Khartabil, J.C. Boisson, J. Contreras-Garcia, Jean-Philip Piquemal, E. Henon To cite this version: J. Klein, H. Khartabil, J.C. Boisson, J. Contreras-Garcia, Jean-Philip Piquemal, et al.. A New Way for Probing Bond Strength. Journal of Physical Chemistry A, American Chemical Society, 2020, 124 (9), pp.1850-1860. 10.1021/acs.jpca.9b09845. hal-02377737 HAL Id: hal-02377737 https://hal.archives-ouvertes.fr/hal-02377737 Submitted on 27 Mar 2021 HAL is a multi-disciplinary open access L’archive ouverte pluridisciplinaire HAL, est archive for the deposit and dissemination of sci- destinée au dépôt et à la diffusion de documents entific research documents, whether they are pub- scientifiques de niveau recherche, publiés ou non, lished or not. The documents may come from émanant des établissements d’enseignement et de teaching and research institutions in France or recherche français ou étrangers, des laboratoires abroad, or from public or private research centers. publics ou privés. A New Way for Probing Bond Strength Johanna Klein,y Hassan Khartabil,y Jean-Charles Boisson,z Julia Contreras-Garc´ıa,{ Jean-Philip Piquemal,{ and Eric H´enon∗,y yInstitut de Chimie Mol´eculaire de Reims UMR CNRS 7312, Universit´ede Reims Champagne-Ardenne, Moulin de la Housse 51687 Reims Cedex 02 BP39 (France) zCReSTIC EA 3804, Universit´ede Reims Champagne-Ardenne, Moulin de la Housse 51687 Reims Cedex 02 BP39 (France) {Sorbonne Universit´es,UPMC, Laboratoire de Chimie Th´eoriqueand UMR CNRS 7616, 4 Pl Jussieu, 75252 Paris Cedex 05(France) E-mail: [email protected] Phone: +33(3)26918497 1 Abstract The covalent chemical bond is intimately linked to electron sharing between atoms. -
Bond Distances and Bond Orders in Binuclear Metal Complexes of the First Row Transition Metals Titanium Through Zinc
Metal-Metal (MM) Bond Distances and Bond Orders in Binuclear Metal Complexes of the First Row Transition Metals Titanium Through Zinc Richard H. Duncan Lyngdoh*,a, Henry F. Schaefer III*,b and R. Bruce King*,b a Department of Chemistry, North-Eastern Hill University, Shillong 793022, India B Centre for Computational Quantum Chemistry, University of Georgia, Athens GA 30602 ABSTRACT: This survey of metal-metal (MM) bond distances in binuclear complexes of the first row 3d-block elements reviews experimental and computational research on a wide range of such systems. The metals surveyed are titanium, vanadium, chromium, manganese, iron, cobalt, nickel, copper, and zinc, representing the only comprehensive presentation of such results to date. Factors impacting MM bond lengths that are discussed here include (a) n+ the formal MM bond order, (b) size of the metal ion present in the bimetallic core (M2) , (c) the metal oxidation state, (d) effects of ligand basicity, coordination mode and number, and (e) steric effects of bulky ligands. Correlations between experimental and computational findings are examined wherever possible, often yielding good agreement for MM bond lengths. The formal bond order provides a key basis for assessing experimental and computationally derived MM bond lengths. The effects of change in the metal upon MM bond length ranges in binuclear complexes suggest trends for single, double, triple, and quadruple MM bonds which are related to the available information on metal atomic radii. It emerges that while specific factors for a limited range of complexes are found to have their expected impact in many cases, the assessment of the net effect of these factors is challenging. -
10: Alkenes and Alkynes. Electrophilic and Concerted Addition Reactions
(2/94)(8,9/96)(12/03)(1,2/04) Neuman Chapter 10 10: Alkenes and Alkynes. Electrophilic and Concerted Addition Reactions Addition Reactions Electrophilic Addition of H-X or X2 to Alkenes Addition of H-X and X2 to Alkynes Alkenes to Alcohols by Electrophilic Addition Alkenes to Alcohols by Hydroboration Addition of H2 to Alkenes and Alkynes Preview (To be added) 10.1 Addition Reactions We learned about elimination reactions that form C=C and Cº C bonds in Chapter 9. In this chapter we learn about reactions in which reagents add to these multiple bonds. General Considerations (10.1A) We show a general equation for an addition reaction with an alkene in Figure 10.01. Figure 10.01 (see Figure folder for complete figure) A¾ B A B | | C=C ® C¾ C This equation is the reverse of the general equation for an elimination reaction that we showed at the beginning of Chapter 9. This general equation does not show a mechanism for the addition process. There are a number of different types of mechanisms for addition reactions, but we can group them into the four broad categories of (1) electrophilic addition, (2) nucleophilic addition, (3) free radical addition, and (4) concerted addition. Electrophilic and nucleophilic addition reactions involve intermediate ions so they are ionic addition reactions. In contrast, free radical additions, and 1 (2/94)(8,9/96)(12/03)(1,2/04) Neuman Chapter 10 concerted addition reactions, are non-ionic addition reactions because they do not involve the formation of intermediate ions. Ionic Addition Reactions (10.1B) We compare general features of nucleophilic and electrophilic addition reactions here. -
Noncovalent Interactions Involving Microsolvated Networks of Trimethylamine N-Oxide
University of Mississippi eGrove Electronic Theses and Dissertations Graduate School 2014 Noncovalent Interactions Involving Microsolvated Networks Of Trimethylamine N-Oxide Kristina Andrea Cuellar University of Mississippi Follow this and additional works at: https://egrove.olemiss.edu/etd Part of the Physical Chemistry Commons Recommended Citation Cuellar, Kristina Andrea, "Noncovalent Interactions Involving Microsolvated Networks Of Trimethylamine N-Oxide" (2014). Electronic Theses and Dissertations. 407. https://egrove.olemiss.edu/etd/407 This Thesis is brought to you for free and open access by the Graduate School at eGrove. It has been accepted for inclusion in Electronic Theses and Dissertations by an authorized administrator of eGrove. For more information, please contact [email protected]. NONCOVALENT INTERACTIONS INVOLVING MICROSOLVATED NETWORKS OF TRIMETHYLAMINE N-OXIDE Kristina A. Cuellar A thesis submitted in partial fulfillment of the requirements for the degree of Master of Science Physical Chemistry University of Mississippi August 2014 Copyright © 2014 Kristina A. Cuellar All rights reserved. ABSTRACT This thesis research focuses on the effects of the formation of hydrogen-bonded networks with the important osmolyte trimethylamine N-oxide (TMAO). Vibrational spectroscopy, in this case Raman spectroscopy, is used to interpret the effects of noncovalent interactions by solvation with select hydrogen bond donors such as water, methanol, ethanol and ethylene glycol in the form of slight changes in vibrational frequencies. Spectral shifts in the experimental Raman spectra of interacting molecules are compared to the results of electronic structure calculations on explicit hydrogen bonded molecular clusters. The similarities in the Raman spectra of microsolvated TMAO using a variety of hydrogen bond donors suggest a common structural motif in all of the hydrogen bonded complexes. -
Organic and Biological Chemistry
CHAPTER 23 Organic and Biological Chemistry CONTENTS HO H 23.1 ▶ Organic Molecules and Their C Structures: Alkanes H H C 23.2 ▶ Families of Organic Compounds: HO O O C C Functional Groups 23.3 ▶ Naming Organic Compounds H CC 23.4 ▶ Carbohydrates:HO A Biological Example HO OH of Isomers H 23.5 ▶ Valence Bond TCheory and Orbital OverlapH Pictures H C 23.6 ▶ Lipids:HO A Biological EOxample ofO Cis–Trans IsomerismC C 23.7 ▶ Formal Charge and Resonance in Organic CompoundsH CC 23.8 ▶ Conjugated SystemsHO OH 23.9 ▶ Proteins: A Biological Example of Conjugation 23.10 ▶ Aromatic Compounds and Molecular Ascorbic acid, also known as vitamin C, is an essential nutrient in the human diet Orbital Theory because it is not synthesized in our body. We can eat citrus fruits or take pills that contain vitamin C to maintain health. 23.11 ▶ Nucleic Acids: A Biological Example of Aromaticity ? Which Is Better, Natural or Synthetic? The answer to this question can be found in the INQUIRY ▶▶▶ on page 1021. STUDY GUIDE M23_MCMU3170_07_SE_C23.indd 978 27/11/14 2:11 AM f the ultimate goal of chemistry is to understand the world around us on a molecular level, then a knowledge of biochemistry—the chemistry of living organisms—is a central part Iof that goal. Biochemistry, in turn, is a branch of organic chemistry, a term originally used to mean the study of compounds from living organisms while inorganic chemistry was used for the study of compounds from nonliving sources. Today, however, we know that there are no fundamental differences between organic and inorganic compounds; the same principles apply to both. -
Hydrogen Bond
HYDROGEN BOND Hydrogen bond is not a real bond, actually it is a type of electrostatic attraction. It plays very important role in the case of water. So let’s learn more about it with the example of water molecule. You have studied bonding and hybridization of H2O molecule. H2O is a bent shaped molecule. There is a considerable electronegativity difference between H and O atoms which makes the H-O bond polar. More electronegative O pulls bonding pair of electrons and acquires a partial negative charge while Hydrogen develops a partial positive charge. When two molecules of water come closer, the electrostatic force comes in action. Partially negative charged Oxygen of one molecule attracts partially positive charged Hydrogen of another molecule by electrostatic attraction. Electron rich Oxygen shares its lone pair of electron with electron deficient Hydrogen atom and forms an invisible bond of attraction which is called Hydrogen bond. This electrostatic attraction isn’t sufficiently strong to form an ionic bond and the electrons are not shared enough to make it a coordinate covalent bond, but this attraction is somehow capable of keeping the molecules together. Hydrogen bond is represented by a dotted line. It is weaker than ionic and covalent bond. But it is solely responsible for the amazing nature of water. Let’s see how it makes water so wonderful. Hydrogen bonds make a network of water molecules which is responsible for the liquid state of water. When we try to evaporate water into vapours, we need to break a large number of hydrogen bonds to let water molecule free from the network. -
1: Organic Molecules and Chemical Bonding
(4,5,9,11,12/98)(1,9,10/99) Neuman Chapter 1 1: Organic Molecules and Chemical Bonding Organic Molecules Chemical Bonds Organic Chemistry Bon voyage Preview Organic chemistry describes the structures, properties, preparation, and reactions of a vast array of molecules that we call organic compounds. There are many different types of organic compounds, but all have carbon as their principal constituent atom. These carbon atoms form a carbon skeleton or carbon backbone that has other bonded atoms such as H, N, O, S, and the halogens (F, Cl, Br, and I). We frequently hear the term "organic" in everyday language where it describes or refers to substances that are "natural". This is probably a result of the notion of early scientists that all organic compounds came from living systems and possessed a "vital force". However, chemists learned over 170 years ago that this is not the case. Organic compounds are major components of living systems, but chemists can make many of them in the laboratory from substances that have no direct connection with living systems. Chemically speaking, a pure sample of an organic compound such as Vitamin C prepared in a laboratory is chemically identical to a pure sample of Vitamin C isolated from a natural source such as an orange or other citrus fruit. Your journey through organic chemistry will be challenging because of the large amount of information that you will need to learn and understand. However, we will explore this subject in a systematic manner so that it is not a vast collection of isolated facts. -
Chemical Bonding and Molecular Structure
100 CHEMISTRY UNIT 4 CHEMICAL BONDING AND MOLECULAR STRUCTURE Scientists are constantly discovering new compounds, orderly arranging the facts about them, trying to explain with the existing knowledge, organising to modify the earlier views or After studying this Unit, you will be evolve theories for explaining the newly observed facts. able to • understand KÖssel-Lewis approach to chemical bonding; • explain the octet rule and its Matter is made up of one or different type of elements. limitations, draw Lewis Under normal conditions no other element exists as an structures of simple molecules; independent atom in nature, except noble gases. However, • explain the formation of different a group of atoms is found to exist together as one species types of bonds; having characteristic properties. Such a group of atoms is • describe the VSEPR theory and called a molecule. Obviously there must be some force predict the geometry of simple which holds these constituent atoms together in the molecules; molecules. The attractive force which holds various • explain the valence bond constituents (atoms, ions, etc.) together in different approach for the formation of chemical species is called a chemical bond. Since the covalent bonds; formation of chemical compounds takes place as a result • predict the directional properties of combination of atoms of various elements in different of covalent bonds; ways, it raises many questions. Why do atoms combine? Why are only certain combinations possible? Why do some • explain the different types of hybridisation involving s, p and atoms combine while certain others do not? Why do d orbitals and draw shapes of molecules possess definite shapes? To answer such simple covalent molecules; questions different theories and concepts have been put forward from time to time.